5-(3-Nitrophenyl)oxazole-4-carboxylic acid


Chemical Name: 5-(3-Nitrophenyl)oxazole-4-carboxylic acid
CAS Number: 951885-28-2
Product Number: AG003M4S(AGN-PC-0570DO)
Synonyms:
MDL No:
Molecular Formula: C10H6N2O5
Molecular Weight: 234.1650

Identification/Properties


Properties
BP:
438 °C at 760 mmHg
Storage:
Room Temperature;
Computed Properties
Molecular Weight:
234.167g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
234.028g/mol
Monoisotopic Mass:
234.028g/mol
Topological Polar Surface Area:
109A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
316
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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